SCHEMBL31477667

SCHEMBL31477667

CCOC(=O)[C@H](N)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.48
CTSS P25774 4/20 0.48
MMP8 P22894 1/20 0.44
MAPT P10636 3/20 0.43
SYK P43405 1/20 0.43
ATM Q13315 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
TSHR P16473 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31503119 1.00 CTSK (0.48) CTSKCTSSMMP8MAPTSYK
SCHEMBL31503086 1.00 CTSK (0.48) CTSKCTSSMMP8MAPTSYK
SCHEMBL12294363 0.88 CTSK (0.48) CTSKCTSSMAPTSYKATM
SCHEMBL31477648 0.88 CTSK (0.48) CTSKCTSSMAPTSYKATM
SCHEMBL12294359 0.88 CTSK (0.48) CTSKCTSSMAPTSYKATM
SCHEMBL12294538 0.86 RAB9A (0.41) CTSKCTSSMAPTALDH1A1CYP1A2
SCHEMBL10463735 0.86 CTSK (0.49) CTSKCTSSMMP8MAPTSYK
SCHEMBL31477126 0.86 CTSK (0.49) CTSKCTSSMMP8MAPTSYK
SCHEMBL31344398 0.85 CTSK (0.50) CTSKCTSSMAPTATMCTSL
SCHEMBL31477442 0.85 CTSK (0.50) CTSKCTSSMAPTATMCTSL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025085564-A1 LYSINE ACETYLTRANSFERASE INHIBITORS Kronos Bio, Inc. (US) 2025-04-24 WO disclosed
WO-2025085554-A1 LYSINE ACETYLTRANSFERASE INHIBITORS Kronos Bio, Inc. (US) 2025-04-24 WO disclosed